methyl (2R,3S)-2-[2-[4-(1H-indol-3-yl)butanoyloxy]ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[2-[4-(1H-indol-3-yl)butanoyloxy]ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[2-[4-(1H-indol-3-yl)butanoyloxy]acetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[4-(1H-indol-3-yl)-1-oxobutoxy]-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[2-[4-(1H-indol-3-yl)butanoyloxy]acetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[4-(1H-indol-3-yl)butanoyloxy]acetyl]amino]-3-methyl-valeric acid methyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC(=O)CCCC1=CNC2=CC=CC=C21

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)COC(=O)CCCC1=CNC2=CC=CC=C21

InChI

InChI=1S/C21H28N2O5/c1-4-14(2)20(21(26)27-3)23-18(24)13-28-19(25)11-7-8-15-12-22-17-10-6-5-9-16(15)17/h5-6,9-10,12,14,20,22H,4,7-8,11,13H2,1-3H3,(H,23,24)/t14-,20+/m0/s1