methyl (2S)-2-[(7-hexyl-1H-indol-4-yl)-methyl-amino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[(7-hexyl-1H-indol-4-yl)-methyl-amino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(7-hexyl-1H-indol-4-yl)-methyl-amino]-3-methyl-butanoate CAS Name: (2S)-2-[(7-hexyl-1H-indol-4-yl)-methylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(7-hexyl-1H-indol-4-yl)-methylamino]-3-methylbutanoate Traditional Name: (2S)-2-[(7-hexyl-1H-indol-4-yl)-methyl-amino]-3-methyl-butyric acid methyl ester Formula: C21H32N2O2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C2C(=C(C=C1)N(C)C(C(C)C)C(=O)OC)C=CN2

Isomeric SMILES

CCCCCCC1=C2C(=C(C=C1)N(C)[C@@H](C(C)C)C(=O)OC)C=CN2

InChI

InChI=1S/C21H32N2O2/c1-6-7-8-9-10-16-11-12-18(17-13-14-22-19(16)17)23(4)20(15(2)3)21(24)25-5/h11-15,20,22H,6-10H2,1-5H3/t20-/m0/s1