N-[6-(acridin-9-ylamino)hexyl]-3,4-dinitro-benzamide hydrochloride

Systemtic Name: N-[6-(acridin-9-ylamino)hexyl]-3,4-dinitro-benzamide hydrochloride Openeye Name: N-[6-(acridin-9-ylamino)hexyl]-3,4-dinitro-benzamide hydrochloride CAS Name: N-[6-(9-acridinylamino)hexyl]-3,4-dinitrobenzamide hydrochloride IUPAC Name: N-[6-(acridin-9-ylamino)hexyl]-3,4-dinitrobenzamide hydrochloride Traditional Name: N-[6-(acridin-9-ylamino)hexyl]-3,4-dinitro-benzamide hydrochloride Formula: C26H26ClN5O5 MolecularWeight: 523.96814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCNC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])[N+](=O)[O-].Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCNC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])[N+](=O)[O-].Cl

InChI

InChI=1S/C26H25N5O5.ClH/c32-26(18-13-14-23(30(33)34)24(17-18)31(35)36)28-16-8-2-1-7-15-27-25-19-9-3-5-11-21(19)29-22-12-6-4-10-20(22)25;/h3-6,9-14,17H,1-2,7-8,15-16H2,(H,27,29)(H,28,32);1H