methyl (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroxyimino-3-oxidanylidene-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroxyimino-3-oxidanylidene-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroxyimino-3-oxo-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butanoate CAS Name: (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroxyimino-3-oxopropyl]-7-hexyl-1H-indol-4-yl]-methylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroxyimino-3-oxopropyl]-7-hexyl-1H-indol-4-yl]-methylamino]-3-methylbutanoate Traditional Name: (2S)-2-[[3,5-bis[(2Z)-3-ethoxy-2-hydroximino-3-keto-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butyric acid methyl ester Formula: C31H46N4O8 MolecularWeight: 602.71894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C2=C1NC=C2CC(=NO)C(=O)OCC)N(C)C(C(C)C)C(=O)OC)CC(=NO)C(=O)OCC

Isomeric SMILES

CCCCCCC1=CC(=C(C2=C1NC=C2C/C(=N/O)/C(=O)OCC)N(C)[C@@H](C(C)C)C(=O)OC)C/C(=N/O)/C(=O)OCC

InChI

InChI=1S/C31H46N4O8/c1-8-11-12-13-14-20-15-21(16-23(33-39)29(36)42-9-2)28(35(6)27(19(4)5)31(38)41-7)25-22(18-32-26(20)25)17-24(34-40)30(37)43-10-3/h15,18-19,27,32,39-40H,8-14,16-17H2,1-7H3/b33-23-,34-24-/t27-/m0/s1