[1-(3-methylbutyl)indol-3-yl]methyl 5-azanyl-3-methoxy-2-methyl-benzoate

Systemtic Name: [1-(3-methylbutyl)indol-3-yl]methyl 5-azanyl-3-methoxy-2-methyl-benzoate Openeye Name: (1-isopentylindol-3-yl)methyl 5-amino-3-methoxy-2-methyl-benzoate CAS Name: 5-amino-3-methoxy-2-methylbenzoic acid [1-(3-methylbutyl)-3-indolyl]methyl ester IUPAC Name: [1-(3-methylbutyl)indol-3-yl]methyl 5-amino-3-methoxy-2-methylbenzoate Traditional Name: 5-amino-3-methoxy-2-methyl-benzoic acid (1-isoamylindol-3-yl)methyl ester Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C(=O)OCC2=CN(C3=CC=CC=C32)CCC(C)C)N)OC

Isomeric SMILES

CC1=C(C=C(C=C1C(=O)OCC2=CN(C3=CC=CC=C32)CCC(C)C)N)OC

InChI

InChI=1S/C23H28N2O3/c1-15(2)9-10-25-13-17(19-7-5-6-8-21(19)25)14-28-23(26)20-11-18(24)12-22(27-4)16(20)3/h5-8,11-13,15H,9-10,14,24H2,1-4H3