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

Systemtic Name: 3-[3-(1-azanylethenylamino)propyl]-1-(naphthalen-2-ylmethylcarbamoyl)-4-oxidanylidene-azetidine-2-carboxylic acid Openeye Name: 3-[3-(1-aminovinylamino)propyl]-1-(2-naphthylmethylcarbamoyl)-4-oxo-azetidine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethenylamino)propyl]-1-[(2-naphthalenylmethylamino)-oxomethyl]-4-oxo-2-azetidinecarboxylic acid IUPAC Name: 3-[3-(1-aminoethenylamino)propyl]-1-(naphthalen-2-ylmethylcarbamoyl)-4-oxoazetidine-2-carboxylic acid Traditional Name: 3-[3-(1-aminovinylamino)propyl]-4-keto-1-(2-naphthylmethylcarbamoyl)azetidine-2-carboxylic acid Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

C=C(N)NCCCC1C(N(C1=O)C(=O)NCC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

C=C(N)NCCCC1C(N(C1=O)C(=O)NCC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C21H24N4O4/c1-13(22)23-10-4-7-17-18(20(27)28)25(19(17)26)21(29)24-12-14-8-9-15-5-2-3-6-16(15)11-14/h2-3,5-6,8-9,11,17-18,23H,1,4,7,10,12,22H2,(H,24,29)(H,27,28)