4-[1-(2-azanylpropanoyloxy)naphthalen-2-yl]-3-[2-[ethyl(4-piperidin-4-ylbutanoyl)amino]ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-(2-azanylpropanoyloxy)naphthalen-2-yl]-3-[2-[ethyl(4-piperidin-4-ylbutanoyl)amino]ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[1-(2-aminopropanoyloxy)-2-naphthyl]-3-[[2-[ethyl-[4-(4-piperidyl)butanoyl]amino]acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-[1-(2-amino-1-oxopropoxy)-2-naphthalenyl]-3-[[2-[ethyl-[1-oxo-4-(4-piperidinyl)butyl]amino]-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[1-(2-aminopropanoyloxy)naphthalen-2-yl]-3-[[2-[ethyl(4-piperidin-4-ylbutanoyl)amino]acetyl]amino]-4-oxobutanoic acid Traditional Name: 4-(1-alanyloxy-2-naphthyl)-3-[[2-[ethyl-[4-(4-piperidyl)butanoyl]amino]acetyl]amino]-4-keto-butyric acid Formula: C30H40N4O7 MolecularWeight: 568.6612

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(CC(=O)O)C(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C(C)N)C(=O)CCCC3CCNCC3

Isomeric SMILES

CCN(CC(=O)NC(CC(=O)O)C(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C(C)N)C(=O)CCCC3CCNCC3

InChI

InChI=1S/C30H40N4O7/c1-3-34(26(36)10-6-7-20-13-15-32-16-14-20)18-25(35)33-24(17-27(37)38)28(39)23-12-11-21-8-4-5-9-22(21)29(23)41-30(40)19(2)31/h4-5,8-9,11-12,19-20,24,32H,3,6-7,10,13-18,31H2,1-2H3,(H,33,35)(H,37,38)