methyl 4-[[5-azanyl-1-(cyclopropylmethyl)indol-3-yl]methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-azanyl-1-(cyclopropylmethyl)indol-3-yl]methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-amino-1-(cyclopropylmethyl)indol-3-yl]methyl]-3-methoxy-benzoate CAS Name: 4-[[5-amino-1-(cyclopropylmethyl)-3-indolyl]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-amino-1-(cyclopropylmethyl)indol-3-yl]methyl]-3-methoxybenzoate Traditional Name: 4-[[5-amino-1-(cyclopropylmethyl)indol-3-yl]methyl]-3-methoxy-benzoic acid methyl ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)N)CC4CC4

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CC2=CN(C3=C2C=C(C=C3)N)CC4CC4

InChI

InChI=1S/C22H24N2O3/c1-26-21-10-16(22(25)27-2)6-5-15(21)9-17-13-24(12-14-3-4-14)20-8-7-18(23)11-19(17)20/h5-8,10-11,13-14H,3-4,9,12,23H2,1-2H3