N,N-bis(2-chloroethyl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-1,8-naphthyridine-3-carboxamide

Systemtic Name: N,N-bis(2-chloroethyl)-1-[(4-methylphenyl)methyl]-2-oxidanylidene-1,8-naphthyridine-3-carboxamide Openeye Name: N,N-bis(2-chloroethyl)-2-oxo-1-(p-tolylmethyl)-1,8-naphthyridine-3-carboxamide CAS Name: N,N-bis(2-chloroethyl)-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide IUPAC Name: N,N-bis(2-chloroethyl)-1-[(4-methylphenyl)methyl]-2-oxo-1,8-naphthyridine-3-carboxamide Traditional Name: N,N-bis(2-chloroethyl)-2-keto-1-(4-methylbenzyl)-1,8-naphthyridine-3-carboxamide Formula: C21H21Cl2N3O2 MolecularWeight: 418.31634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=C(C=CC=N3)C=C(C2=O)C(=O)N(CCCl)CCCl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=C(C=CC=N3)C=C(C2=O)C(=O)N(CCCl)CCCl

InChI

InChI=1S/C21H21Cl2N3O2/c1-15-4-6-16(7-5-15)14-26-19-17(3-2-10-24-19)13-18(21(26)28)20(27)25(11-8-22)12-9-23/h2-7,10,13H,8-9,11-12,14H2,1H3