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

Systemtic Name: methyl (2S)-2-[[5-[(2Z)-3-ethoxy-2-hydroxyimino-3-oxidanylidene-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[[5-[(2Z)-3-ethoxy-2-hydroxyimino-3-oxo-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butanoate CAS Name: (2S)-2-[[5-[(2Z)-3-ethoxy-2-hydroxyimino-3-oxopropyl]-7-hexyl-1H-indol-4-yl]-methylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-[(2Z)-3-ethoxy-2-hydroxyimino-3-oxopropyl]-7-hexyl-1H-indol-4-yl]-methylamino]-3-methylbutanoate Traditional Name: (2S)-2-[[5-[(2Z)-3-ethoxy-2-hydroximino-3-keto-propyl]-7-hexyl-1H-indol-4-yl]-methyl-amino]-3-methyl-butyric acid methyl ester Formula: C26H39N3O5 MolecularWeight: 473.60496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H39N3O5/c1-7-9-10-11-12-18-15-19(16-21(28-32)25(30)34-8-2)24(20-13-14-27-22(18)20)29(5)23(17(3)4)26(31)33-6/h13-15,17,23,27,32H,7-12,16H2,1-6H3/b28-21-/t23-/m0/s1