5-[(4-chlorophenyl)amino]-3-(2-piperidin-1-ylethylamino)-2,1-benzoxazole-4,7-dione

Systemtic Name: 5-[(4-chlorophenyl)amino]-3-(2-piperidin-1-ylethylamino)-2,1-benzoxazole-4,7-dione Openeye Name: 5-(4-chloroanilino)-3-[2-(1-piperidyl)ethylamino]-2,1-benzoxazole-4,7-dione CAS Name: 5-(4-chloroanilino)-3-[2-(1-piperidinyl)ethylamino]-2,1-benzoxazole-4,7-dione IUPAC Name: 5-(4-chloroanilino)-3-(2-piperidin-1-ylethylamino)-2,1-benzoxazole-4,7-dione Traditional Name: 5-(4-chloroanilino)-3-(2-piperidinoethylamino)anthranil-4,7-quinone Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC2=C3C(=NO2)C(=O)C=C(C3=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(CC1)CCNC2=C3C(=NO2)C(=O)C=C(C3=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O3/c21-13-4-6-14(7-5-13)23-15-12-16(26)18-17(19(15)27)20(28-24-18)22-8-11-25-9-2-1-3-10-25/h4-7,12,22-23H,1-3,8-11H2