2-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one

Systemtic Name: 2-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one Openeye Name: 2-[3-(chroman-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one CAS Name: 2-[3-(3,4-dihydro-2H-1-benzopyran-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one IUPAC Name: 2-[3-(3,4-dihydro-2H-chromen-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one Traditional Name: 2-[3-(chroman-2-ylmethylamino)propylamino]-1,4,5,6-tetrahydro-1,3-diazepin-7-one Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC(=NC1)NCCCNCC2CCC3=CC=CC=C3O2

Isomeric SMILES

C1CC(=O)NC(=NC1)NCCCNCC2CCC3=CC=CC=C3O2

InChI

InChI=1S/C18H26N4O2/c23-17-7-3-11-20-18(22-17)21-12-4-10-19-13-15-9-8-14-5-1-2-6-16(14)24-15/h1-2,5-6,15,19H,3-4,7-13H2,(H2,20,21,22,23)