methyl 5-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethyl)indol-5-yl]oxypentanoate

Systemtic Name: methyl 5-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethyl)indol-5-yl]oxypentanoate Openeye Name: methyl 5-[3-(2-amino-2-oxo-ethyl)-1-benzyl-2-methyl-indol-5-yl]oxypentanoate CAS Name: 5-[[3-(2-amino-2-oxoethyl)-2-methyl-1-(phenylmethyl)-5-indolyl]oxy]pentanoic acid methyl ester IUPAC Name: methyl 5-[3-(2-amino-2-oxoethyl)-1-benzyl-2-methylindol-5-yl]oxypentanoate Traditional Name: 5-[3-(2-amino-2-keto-ethyl)-1-benzyl-2-methyl-indol-5-yl]oxyvaleric acid methyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCCCCC(=O)OC)CC(=O)N

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)OCCCCC(=O)OC)CC(=O)N

InChI

InChI=1S/C24H28N2O4/c1-17-20(15-23(25)27)21-14-19(30-13-7-6-10-24(28)29-2)11-12-22(21)26(17)16-18-8-4-3-5-9-18/h3-5,8-9,11-12,14H,6-7,10,13,15-16H2,1-2H3,(H2,25,27)