3-(9-oxaspiro[4.4]nonan-4-ylamino)-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(9-oxaspiro[4.4]nonan-4-ylamino)-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione Openeye Name: 3-(benzylamino)-4-(9-oxaspiro[4.4]nonan-4-ylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(9-oxaspiro[4.4]nonan-4-ylamino)-4-[(phenylmethyl)amino]cyclobut-3-ene-1,2-dione IUPAC Name: 3-(benzylamino)-4-(9-oxaspiro[4.4]nonan-4-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(benzylamino)-4-(9-oxaspiro[4.4]nonan-4-ylamino)cyclobut-3-ene-1,2-quinone Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2(C1)CCCO2)NC3=C(C(=O)C3=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC(C2(C1)CCCO2)NC3=C(C(=O)C3=O)NCC4=CC=CC=C4

InChI

InChI=1S/C19H22N2O3/c22-17-15(20-12-13-6-2-1-3-7-13)16(18(17)23)21-14-8-4-9-19(14)10-5-11-24-19/h1-3,6-7,14,20-21H,4-5,8-12H2