3-[3-(1-azanylethenylamino)propyl]-1-(1-naphthalen-1-ylethylcarbamoyl)-4-oxidanylidene-azetidine-2-carboxylic acid

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-1-(1-naphthalen-1-ylethylcarbamoyl)-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 3-[3-(1-aminovinylamino)propyl]-1-[1-(1-naphthyl)ethylcarbamoyl]-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-1-(1-naphthalen-1-ylethylcarbamoyl)-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[3-(1-aminovinylamino)propyl]-4-keto-1-[1-(1-naphthyl)ethylcarbamoyl]azetidine-2-carboxylic acid Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)N3C(C(C3=O)CCCNC(=C)N)C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)N3C(C(C3=O)CCCNC(=C)N)C(=O)O

InChI

InChI=1S/C22H26N4O4/c1-13(16-10-5-8-15-7-3-4-9-17(15)16)25-22(30)26-19(21(28)29)18(20(26)27)11-6-12-24-14(2)23/h3-5,7-10,13,18-19,24H,2,6,11-12,23H2,1H3,(H,25,30)(H,28,29)